COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL330471
Chemical Name: (4Z)-2-(3-bromophenyl)-4-[(2E)-3-(4-nitrophenyl)prop-2-en-1-ylidene]-1,3-oxazol-5(4H)-one
Smiles: Brc1cccc(c1)C1=N/C(=C\C=C\c2ccc(cc2)[N+](=O)[O-])/C(=O)O1

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Molecular Weight: 399.2
Empirical Formula: C18H11BrN2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.227
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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